SMILES:
COc1ccc2c(Nc3c(Cl)cncc3Cl)cc(=O)oc2c1OCCCCCCCCN(C)CMolecular Processing
Molecular formula
C25H31Cl2N3O4
Molecular weight
508.45
Exact mass
507.1692
XLogP
6.53
TPSA
76.83
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
13
Heavy atoms
34
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.44
Molar refractivity
138.33
Supplementary Information
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